22-Dehydro Cholesterol-d7 3-Acetate

Product Specifications

Synonyms

5,22E-Cholestadien-3beta-ol-d7 Acetate; 5,22E-Cholestadien-3beta-yl-d7 Acetate; (3beta,22E)-Cholesta-5,22-dien-3-ol-d7 3-Acetate

Hazard Statement

No Data Available

Smiles

[2H]C([2H])([2H])C([2H])(C\C=C\[C@@H](C)C1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C)C([2H])([2H])[2H]

Molecular Formula

C29 D7 H39 O2

Molecular Weight

433.717

InChI

InChI=1S/C29H46O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,9-10,19-20,23-27H,8,11-18H2,1-6H3/b9-7+/t20-,23+,24+,25?,26+,27+,28+,29-/m1/s1/i1D3,2D3,19D

Additionnal Information

IUPAC name: [(3S,8S,9S,10R,13R,14S)-10,13-dimethyl-17-[(E,2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)hept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate